<![CDATA[Multiwfn forum / Question about NICS calculations using ORCA]]> http://sobereva.com/wfnbbs/viewtopic.php?id=1889 Thu, 15 Oct 2026 14:45:54 +0000 FluxBB <![CDATA[Re: Question about NICS calculations using ORCA]]> http://sobereva.com/wfnbbs/viewtopic.php?pid=5861#p5861 They are realized via Multiwfn, unfortunately, this function is currently not possible for ORCA users. Please check this post for reason: http://sobereva.com/wfnbbs/viewtopic.php?id=1847

]]> Thu, 15 Oct 2026 14:45:54 +0000 http://sobereva.com/wfnbbs/viewtopic.php?pid=5861#p5861 <![CDATA[Question about NICS calculations using ORCA]]> http://sobereva.com/wfnbbs/viewtopic.php?pid=5860#p5860 I would like to ask whether it is possible to calculate the NICS values presented in Figure 5 and Table 5 of your paper (DOI: 10.1002/chem.202403369) using ORCA.

Thank you for your time and help.

]]> Thu, 15 Oct 2026 12:09:36 +0000 http://sobereva.com/wfnbbs/viewtopic.php?pid=5860#p5860